| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:20 UTC |
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| Update Date | 2025-03-25 00:47:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158745 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H22N2O2 |
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| Molecular Mass | 286.1681 |
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| SMILES | OC1CC(C(O)c2c[nH]c3ccccc23)N2CCCCC12 |
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| InChI Key | JTYBDFQDRFZGKW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | indoles and derivatives |
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| Subclass | indoles |
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| Direct Parent | indoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsaromatic alcoholsazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesindolizidinesn-alkylpyrrolidinesorganopnictogen compoundspiperidinespyrrolessecondary alcoholstrialkylamines |
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| Substituents | aromatic alcoholindolearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpyrrolidinepiperidinetertiary aminealcoholindolizidineazacyclen-alkylpyrrolidine1,2-aminoalcoholheteroaromatic compoundtertiary aliphatic amineorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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